- InChI
- InChI=1S/C11H22/c1-3-7-10(2)11-8-5-4-6-9-11/h10-11H,3-9H2,1-2H3
- InChI Key
- ZYJFJURMFHCWOB-UHFFFAOYSA-N
- Formula
- C11H22
- SMILES
- CCCC(C)C1CCCCC1
- Molecular Weight1
- 154.30
- Other Names
-
- 2-cyclohexylpentane
- ω : Acentric Factor.
- Cp,gas : Ideal gas heat capacity (J/mol×K).
- η : Dynamic viscosity (Pa×s).
- ΔfH°gas : Enthalpy of formation at standard conditions (kJ/mol).
- ΔfusH° : Enthalpy of fusion at standard conditions (kJ/mol).
- ΔvapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
- IE : Ionization energy (eV).
- logPoct/wat : Octanol/Water partition coefficient.
- McVol : McGowan's characteristic volume (ml/mol).
- Pc : Critical Pressure (kPa).
- Tboil : Normal Boiling Point Temperature (K).
- Tc : Critical Temperature (K).
- Tfus : Normal melting (fusion) point (K).
- 1: Molecular weight from the IUPAC atomic weights tables.
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Physical Properties
| Property | Value | Unit | Source |
|---|---|---|---|
| ω | 0.3299 | Relay (1.0) Calculated Property | |
| ΔfH°gas | -213.23 | kJ/mol | Relay (1.0) Calculated Property |
| ΔfusH° | 12.56 | kJ/mol | Joback Calculated Property |
| ΔvapH° | 52.25 | kJ/mol | Relay (1.0) Calculated Property |
| IE | 9.52 | eV | Relay (1.0) Calculated Property |
| logPoct/wat | 4.003 | Crippen Calculated Property | |
| McVol | 154.990 | ml/mol | McGowan Calculated Property |
| Pc | 2354.20 | kPa | Joback Calculated Property |
| Tboil | 470.30 | K | Relay (1.0) Calculated Property |
| Tc | 669.95 | K | Relay (1.0) Calculated Property |
| Tfus | 190.32 | K | Relay (1.0) Calculated Property |
Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Log10 of Water solubility in mol/l for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.
Correlations
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| Cp,gas | [200.40; 572.44] | J/mol×K | [273.00; 1000.00] |
Joback Predicted correlation
|
| Equation | Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K | |||
| Coefficient A | -7.43980e+01 | |||
| Coefficient B | 1.17684e+00 | |||
| Coefficient C | -6.58800e-04 | |||
| Coefficient D | 1.28800e-07 | |||
| Coefficient E | 0.00000e+00 | |||
| Temperature range, min. | 273.00 | |||
| Temperature range, max. | 1000.00 | |||
| Cp,gas | 200.40 | J/mol×K | 273.00 | Calculated Property |
| Cp,gas | 265.19 | J/mol×K | 353.78 | Calculated Property |
| Cp,gas | 323.17 | J/mol×K | 434.56 | Calculated Property |
| Cp,gas | 374.74 | J/mol×K | 515.33 | Calculated Property |
| Cp,gas | 420.31 | J/mol×K | 596.11 | Calculated Property |
| Cp,gas | 460.29 | J/mol×K | 676.89 | Calculated Property |
| Cp,gas | 495.09 | J/mol×K | 757.67 | Calculated Property |
| Cp,gas | 525.10 | J/mol×K | 838.44 | Calculated Property |
| Cp,gas | 550.75 | J/mol×K | 919.22 | Calculated Property |
| Cp,gas | 572.44 | J/mol×K | 1000.00 | Calculated Property |
| Property | Value | Unit | Temperature (K) | Source |
|---|---|---|---|---|
| η | [0.0145054; 0.0002405] | Pa×s | [206.11; 468.63] |
Joback Predicted correlation
|
| Equation | Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K | |||
| Coefficient A | -1.15511e+01 | |||
| Coefficient B | 1.50829e+03 | |||
| Coefficient C | 0.00000e+00 | |||
| Coefficient D | 0.00000e+00 | |||
| Coefficient E | 0.00000e+00 | |||
| Comment | Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc. | |||
| Temperature range, min. | 206.11 | |||
| Temperature range, max. | 468.63 | |||
| η | 0.0145054 | Pa×s | 206.11 | Calculated Property |
| η | 0.0058549 | Pa×s | 235.28 | Calculated Property |
| η | 0.0028869 | Pa×s | 264.45 | Calculated Property |
| η | 0.0016382 | Pa×s | 293.62 | Calculated Property |
| η | 0.0010298 | Pa×s | 322.79 | Calculated Property |
| η | 0.0006991 | Pa×s | 351.95 | Calculated Property |
| η | 0.0005036 | Pa×s | 381.12 | Calculated Property |
| η | 0.0003801 | Pa×s | 410.29 | Calculated Property |
| η | 0.0002978 | Pa×s | 439.46 | Calculated Property |
| η | 0.0002405 | Pa×s | 468.63 | Calculated Property |
Similar Compounds
Find more compounds similar to CYCLOHEXANE, (1-METHYLBUTYL)-.
Sources
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